4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=115817.60769433931 stress="-16720.239552486975 -6181.834934311226 -4644.723633878254 -6181.834934311226 -18562.38231577675 1260.9559636988238 -4644.723633878254 1260.9559636988238 -16873.846574137668" pbc="F T T" Tb 0.04172767 -0.05822038 0.20597766 -184709.98268022 -50526.02598570 -110363.41526745 Tb 1.25109896 1.24975095 -0.03269881 164515.77378874 47144.91019356 10623.49554777 Tb 1.23941262 -0.22888836 1.45233546 247281.01437660 108663.21009502 92879.34418443 Tb 0.23407233 1.40437453 1.50176177 -227086.80548511 -105282.09430288 6860.57553524